2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide

C13H18ClN3O — CID 66183463

IUPAC2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide
SMILESCCN(CC(=O)Nc1ccccc1Cl)C1CNC1
InChIInChI=1S/C13H18ClN3O/c1-2-17(10-7-15-8-10)9-13(18)16-12-6-4-3-5-11(12)14/h3-6,10,15H,2,7-9H2,1H3,(H,16,18)
InChIKeyXQKYTCABQCZCFH-UHFFFAOYSA-N
MW267.76 g/mol
LogP1.57
Rot. Bonds5

About 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide

2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide (PubChem CID 66183463) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide.

Molecular Properties

Compound Name2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide
PubChem CID66183463
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide
SMILESCCN(CC(=O)Nc1ccccc1Cl)C1CNC1
InChIInChI=1S/C13H18ClN3O/c1-2-17(10-7-15-8-10)9-13(18)16-12-6-4-3-5-11(12)14/h3-6,10,15H,2,7-9H2,1H3,(H,16,18)
InChIKeyXQKYTCABQCZCFH-UHFFFAOYSA-N
XLogP1.57
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[azetidin-3-yl(ethyl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 66181735
2-[azetidin-3-yl(propyl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 66216307
3-[azetidin-3-yl(methyl)amino]-N-(2-chlorophenyl)propanamide
CID 66186658
N-(2-chloro-3-pyridinyl)-2-[ethyl(pyrrolidin-3-yl)amino]acetamide
CID 63300131
2-[azetidin-3-yl(methyl)amino]-N-(3-chloro-2-methylphenyl)acetamide
CID 66186198
2-[azetidin-3-yl(ethyl)amino]-N-(5-fluoro-2-methylphenyl)acetamide
CID 66181734
2-[azetidin-3-yl(ethyl)amino]-N-(2-bromo-4-methylphenyl)acetamide
CID 66183880
2-[azetidin-3-yl(propyl)amino]-N-(4-bromo-2-chlorophenyl)acetamide
CID 66213695
N-(2-chloro-4-methylphenyl)-2-[ethyl(piperidin-3-yl)amino]acetamide
CID 63637830
2-[azetidin-3-yl(ethyl)amino]-N-(4-bromophenyl)acetamide
CID 66183425
2-[azetidin-3-yl(ethyl)amino]-N-(3,5-difluorophenyl)acetamide
CID 66184313
2-[ethyl(piperidin-4-yl)amino]-N-(2-methylphenyl)acetamide
CID 60805607

Frequently Asked Questions

What is the IUPAC name of 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide?
The IUPAC name of 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide (CID 66183463) is 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide.
What is the SMILES notation for 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide?
The canonical SMILES for 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide is CCN(CC(=O)Nc1ccccc1Cl)C1CNC1.
What is the InChIKey of 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide?
The InChIKey is XQKYTCABQCZCFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O/c1-2-17(10-7-15-8-10)9-13(18)16-12-6-4-3-5-11(12)14/h3-6,10,15H,2,7-9H2,1H3,(H,16,18).
What are the key properties of 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide?
2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide has a molecular weight of 267.76 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide is sourced from PubChem (CID 66183463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).